SCHEMBL31714558

SCHEMBL31714558

Nc1ccc2c(c1)N(C1CC1)C(=O)CC2

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.46
▸ OPRK1 P41145 2/20 0.46
▸ OPRL1 P41146 2/20 0.46
▸ ATAD2 Q6PL18 2/20 0.44
▸ BRD4 O60885 1/20 0.43
▸ NOTUM Q6P988 2/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18019500 0.81 ATAD2 (0.52) OPRM1OPRK1OPRL1ATAD2NOTUM
SCHEMBL2675331 0.78 ATAD2 (0.52) OPRM1OPRK1OPRL1ATAD2NOTUM
SCHEMBL31714491 0.76 GRIN1 (0.42) OPRM1OPRK1OPRL1
SCHEMBL3355838 0.76 CHRM2 (0.47) OPRM1OPRK1OPRL1
SCHEMBL5121645 0.75 OPRM1 (0.45) OPRM1OPRK1OPRL1ATAD2NOTUM
SCHEMBL31714549 0.75 OPRM1 (0.38) OPRM1OPRK1OPRL1NOTUM
SCHEMBL496099 0.75 ATAD2 (0.51) ATAD2BRD4
SCHEMBL12559542 0.74 OPRM1 (0.56) OPRM1OPRK1OPRL1
Hydrochloric Acid SCHEMBL3597662 0.73 ATAD2 (0.50) ATAD2BRD4
SCHEMBL7414811 0.72 HTR2C (0.48) OPRM1OPRK1OPRL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250333407-A1 Compounds and Their Use for Treatment of Hemoglobinopathies BRISTOL-MYERS SQUIBB COMPANY (US) 2025-10-30 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250333407-A1 Compounds and Their Use for Treatment of Hemoglobinopathies HBG1, HBG2, HBB OPRM1 1778/4885OPRK1 2058/4885OPRL1 3570/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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